1-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[2-(2-keto-6,7-dimethyl-1H-quinolin-3-yl)ethyl]thiourea Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NCCC2=CC3=CC(=C(C=C3NC2=O)C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NCCC2=CC3=CC(=C(C=C3NC2=O)C)C)C

InChI

InChI=1S/C23H27N3OS/c1-5-17-8-6-7-14(2)21(17)26-23(28)24-10-9-18-13-19-11-15(3)16(4)12-20(19)25-22(18)27/h6-8,11-13H,5,9-10H2,1-4H3,(H,25,27)(H2,24,26,28)